hexadecyl hydrogen (2Z)-but-2-enedioate
TL;DR: hexadecyl hydrogen (2Z)-but-2-enedioate (CAS 2944-06-1) is a chemical compound with molecular formula C20H36O4 and molecular weight 340.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-hexadecoxy-4-oxobut-2-enoic acid
Also Known As: Hexadecyl hydrogen maleate, 4-hexadecoxy-4-oxobut-2-enoic acid, hexadecyl hydrogen (2Z)-but-2-enedioate, (E)-4-hexadecoxy-4-oxobut-2-enoic acid, (E)-4-hexadecoxy-4-oxo-but-2-enoic acid
| Molecular Formula | C20H36O4 |
|---|---|
| Molecular Weight | 340.26 g/mol |
| LogP | 7.5 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 340.26135 |
| Heavy Atoms | 24 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 2944-06-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOC(=O)C=CC(=O)O |
| InChIKey | YXIQOXQGELPIFQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
hexadecyl hydrogen (2Z)-but-2-enedioate (CAS 2944-06-1), with molecular formula C20H36O4 and molecular weight 340.26 g/mol. IUPAC: 4-hexadecoxy-4-oxobut-2-enoic acid.
Chemical Property Profile of hexadecyl hydrogen (2Z)-but-2-enedioate
Property Insights of hexadecyl hydrogen (2Z)-but-2-enedioate
The XLogP value of 7.5 indicates that hexadecyl hydrogen (2Z)-but-2-enedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for hexadecyl hydrogen (2Z)-but-2-enedioate. Following Lipinski's Rule of Five, hexadecyl hydrogen (2Z)-but-2-enedioate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of hexadecyl hydrogen (2Z)-but-2-enedioate?
The CAS number of hexadecyl hydrogen (2Z)-but-2-enedioate is 2944-06-1.
What is the molecular formula of hexadecyl hydrogen (2Z)-but-2-enedioate?
The molecular formula of hexadecyl hydrogen (2Z)-but-2-enedioate is C20H36O4.
What is the molecular weight of hexadecyl hydrogen (2Z)-but-2-enedioate?
The molecular weight of hexadecyl hydrogen (2Z)-but-2-enedioate is 340.26 g/mol.
Where can I buy hexadecyl hydrogen (2Z)-but-2-enedioate?
You can request a quote for hexadecyl hydrogen (2Z)-but-2-enedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for hexadecyl hydrogen (2Z)-but-2-enedioate?
Yes, KEHONG BIO provides custom synthesis services for hexadecyl hydrogen (2Z)-but-2-enedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.